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Cyclooctanone, 2-(2-methyl-1-oxopropyl)-
SpectraBase Compound ID HKpiA4XDrMz
InChI InChI=1S/C12H20O2/c1-9(2)12(14)10-7-5-3-4-6-8-11(10)13/h9-10H,3-8H2,1-2H3
InChIKey JURVNTDJAUQKGY-UHFFFAOYSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQ5KR3xc6UG
Name Cyclooctanone, 2-(2-methyl-1-oxopropyl)-
Alternate Name(s) 2-Isobutyrylcyclooctanone 2-(2-Methyl-1-oxopropyl)-1-cyclooctanone 2-(2-Methylpropanoyl)cyclooctanone
CAS Registry Number 63858-67-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-9(2)12(14)10-7-5-3-4-6-8-11(10)13/h9-10H,3-8H2,1-2H3
InChIKey JURVNTDJAUQKGY-UHFFFAOYSA-N
Molecular Weight 196.290 g/mol
SMILES C1(C(=O)C(C)C)C(=O)CCCCCC1
SPLASH splash10-0umi-9500000000-bd35f7be1e34b653dfc9
Source of Spectrum H-64-729-0
Wiley ID 1193452